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[Divya Srivastava]

Divya Srivastava
Research Associate
TSU, JNCASR
Jakkur, Bangalore-64
Tel: 080-2208-2834


--- Original message follows ---
Subject: No subject
From: Divya Srivastava <divyasrivastava at jncasr.ac.in>
To: "pw_forum-request at pwscf.org" <pw_forum-request at pwscf.org>
Date: 19-12-2011 10:03


Hi 
I wish to do hybrid DFT on CusScS2 compound. I am not getting proper potential that I can use. 
If I am using "(Cu,Sc,S).pz-n-van_ak.UPF " type of potentials I am getting following error : 
     from setup  : error #         1
     HYBRID XC not implemented for USPP or PAW
I am using espresso-4.3 for this calculation, pbe0.


Divya Srivastava
Research Associate
TSU, JNCASR
Jakkur, Bangalore-64
Tel: 080-2208-2834